[gmx-users] energygrps long-range interaction
gyorgy.hantal at fc.up.pt
gyorgy.hantal at fc.up.pt
Fri Jul 1 19:01:15 CEST 2011
Dear Users,
I'm wondering if it is possible to extract the long-range part of the
interactions of energy-groups. In the output I see only short-range
terms.
I am interested in the total interaction energy of an energy group. I
would guess that one should be able to get the long-range part of the
interactions somehow... Or am I wrong?
Thanks in advance.
Gyorgy
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